3-({(3S,4S)-4-[(6-Amino-2-Pyridinyl)Methyl]-3-Pyrrolidinyl}Amino)-1-Propanol

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Properties Simple | Detailed

Formula C13H22N4O
IUPAC Name 3-[[(3s,4s)-4-[(6-amino-2-pyridyl)methyl]pyrrolidin-3-yl]amino]propan-1-ol
Molecular Mass 250.340 g·mol−1
Heat of Formation -93.2 ± 16.7 kJ·mol−1
Dipole Moment 2.43 ± 1.08 D
Volume 326.96 Å 3
Surface Area 302.76 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy 3.15 ± eV
Point Group Symmetry C1
InChIKey SJAGNBCHAAJNEQ-CMPLNLGQSA-N
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